Asparagine

Asparagine

SCHEMBL7744355

CC(C)[C@H](N)C(=O)O.NC(=O)CC(N)C(=O)O.NCC(=O)O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Asparagine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.54
SLC1A3 P43003 4/20 0.44
SLC1A2 P43004 4/20 0.44
SLC1A1 P43005 3/20 0.44
GRIK1 P39086 9/20 0.41
GRIK2 Q13002 5/20 0.41
GRM1 Q13255 1/20 0.41
GRM2 Q14416 1/20 0.41
GRIA4 P48058 3/20 0.40
GRIK3 Q13003 3/20 0.40
GRIK5 Q16478 3/20 0.40
GRIA2 P42262 2/20 0.40
GRIA1 P42261 1/20 0.40
ALOX15 P16050 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
KMT2A Q03164 1/20 0.38
BHMT Q93088 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Asparagine SCHEMBL8487870 0.93 SLC7A5 (0.62) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Asparagine SCHEMBL1163213 0.93 SLC7A5 (0.62) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Asparagine SCHEMBL8487875 0.93 SLC7A5 (0.62) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Asparagine SCHEMBL8712670 0.93 SLC7A5 (0.62) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Asparagine SCHEMBL8712672 0.93 SLC7A5 (0.62) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Isoleucine SCHEMBL386322 0.91 SLC7A5 (0.44) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Asparagine SCHEMBL26919279 0.89 GSR (0.49) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Asparagine SCHEMBL8892693 0.89 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Asparagine SCHEMBL8892690 0.89 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Aspartic Acid SCHEMBL27476210 0.89 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6428967-B1 DETECTING A STRESS THAT ALTERS A FUNCTIONAL INTERACTION OF AN LOW DENSITY LIPOPROTEIN (LDL) RECEPTOR BINDING POLYPEPTIDE WITH AN LDL RECEPTOR INTERACTION DOMAIN BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2002-08-06 US disclosed